COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL489342
Chemical Name: 2-({1-[3-(benzyloxy)-2-sulfanylpropyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: SC(CN1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)COCc1ccccc1

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Saltdata: HCI
Molecular Weight: 474.62
Empirical Formula: C28H30N2O3S

Available Amount: 0 mg

Lipinsky:
logP: 5.111
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 88
Number of rings: 5

     

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